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ZRROHNVVVWWKBH-VMNXYWKNSA-N
SpectraBase Compound ID IepV9ZE1JIj
InChI InChI=1S/C14H22N6O3S2/c1-19-13-15-3-5-21-7-8-22-6-4-16-14-20(2)18-12(25-14)10-23-9-11(17-19)24-13/h3-10H2,1-2H3/b15-13-,16-14-
InChIKey ZRROHNVVVWWKBH-VMNXYWKNSA-N
Mol Weight 386.49 g/mol
Molecular Formula C14H22N6O3S2
Exact Mass 386.119481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GL9IMVJ9IER
Name [5,5'-(3,6-DIOXA-1,8-OCTANDIYLDIAMINO)-BIS-(4-METHYL-1,3,4-THIADIAZOLO-5-YLIDENE-2-YL)-(OXYDIMETHYLENE)]-PHANE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H22N6O3S2
InChI InChI=1S/C14H22N6O3S2/c1-19-13-15-3-5-21-7-8-22-6-4-16-14-20(2)18-12(25-14)10-23-9-11(17-19)24-13/h3-10H2,1-2H3/b15-13-,16-14-
InChIKey ZRROHNVVVWWKBH-VMNXYWKNSA-N
Literature Reference Author P.MOLINA,A.TARRAGA,C.GASPAR,A.ESPINOSA
Literature Reference Citation J.ORG.CHEM.,59,3665(1994)
Literature Reference DOI 10.1021/jo00092a027
Molecular Weight 386.487 g/mol
Solvent DMSO-D6
Source File Reference UWCP7190